2,6-Dichloro-9-thiabicyclo(3.3.1)nonane
Basic information
- CAS
10502-30-4- Standard SMILES
ClC1CCC2SC1CCC2Cl- InChIKey
QUZIEYDEASXPSN-UHFFFAOYSA-N- Molecular formula
- C8H12Cl2S
- Average molar mass
- 211.15 g/mol
- Monoisotopic mass
- 210.0036769
Overview
structure in first source
Names & identifiers
- Preferred name
- 2,6-Dichloro-9-thiabicyclo(3.3.1)nonane
- IUPAC
- 2,6-dichloro-9-thiabicyclo[3.3.1]nonane
- English name
- 2,6-Dichloro-9-thiabicyclo(3.3.1)nonane
- Molecular formula
- C8H12Cl2S
- Molecular weight
- 211.15
Names & synonyms
2,6-Dichloro-9-thiabicyclo[3.3.1]nonane6522-21-02,6-Dichloro-9-thiabicyclo(3.3.1)nonaneDTXSID701031728RefChem:83175DTXCID301338362NSC 167242WLN: T66 A ASTJ CG GG9-Thiabicyclo(3.3.1)nonane, 2,6-dichloro-SCHEMBL11043324QUZIEYDEASXPSN-UHFFFAOYSA-N10502-30-4
Show more names
9-Thiabicyclo[3.3.1]nonane, 2,6-dichloro-
NSC167242NSC298189NSC691134NSC-167242NSC-298189NSC-6911349-Thiabicyclo[3.3.1]nonane,6-dichloro-9-Thiabicyclo[3.3.1]nonane,2,6-dichloro
Database identifiers
- CAS
10502-30-4、6522-21-0- PubChem CID
- 99035
- DTXSID
DTXSID701031728- Nikkaji
- J48.697C
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 25.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 135
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…